N-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide

C20H23N3O2 — CID 119401596

IUPACN-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide
SMILESO=C(NC(CC(=O)N1CCNCC1)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H23N3O2/c24-19(23-13-11-21-12-14-23)15-18(16-7-3-1-4-8-16)22-20(25)17-9-5-2-6-10-17/h1-10,18,21H,11-15H2,(H,22,25)
InChIKeyOWPKPGWGEVGNDQ-UHFFFAOYSA-N
MW337.42 g/mol
LogP1.98
Rot. Bonds5

About N-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide

N-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide (PubChem CID 119401596) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide.

Molecular Properties

Compound NameN-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide
PubChem CID119401596
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide
SMILESO=C(NC(CC(=O)N1CCNCC1)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H23N3O2/c24-19(23-13-11-21-12-14-23)15-18(16-7-3-1-4-8-16)22-20(25)17-9-5-2-6-10-17/h1-10,18,21H,11-15H2,(H,22,25)
InChIKeyOWPKPGWGEVGNDQ-UHFFFAOYSA-N
XLogP1.98
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(1,4-diazepan-1-yl)-3-oxo-1-phenylpropyl]-4-methylbenzamide;hydrochloride
CID 119418150
2-chloro-N-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide;hydrochloride
CID 119400258
N-[3-(4-ethylpiperazin-1-yl)-3-oxo-1-phenylpropyl]benzamide
CID 78774048
N-[3-(4-aminopiperidin-1-yl)-3-oxo-1-phenylpropyl]benzamide;hydrochloride
CID 119374484
N-[3-[(3R)-3-aminopyrrolidin-1-yl]-3-oxo-1-phenylpropyl]benzamide
CID 119410927
N-[(1S)-3-oxo-1-phenyl-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]benzamide
CID 26009471
N-[(1R)-3-oxo-1-phenyl-3-[4-(pyridin-4-ylmethyl)piperazin-1-yl]propyl]benzamide
CID 31397372
3-benzamido-3-phenylpropanoic acid
CID 2834576
(3S)-3-benzamido-3-phenylpropanoic acid
CID 788098
N-(1-oxo-3-phenyl-1-piperazin-1-ylpropan-2-yl)benzamide
CID 119400548
1-(3-benzamido-3-phenylpropanoyl)-5-methylpiperidine-3-carboxylic acid
CID 122119404
4-(3-benzamido-3-phenylpropanoyl)morpholine-2-carboxylic acid
CID 119239627

Frequently Asked Questions

What is the IUPAC name of N-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide?
The IUPAC name of N-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide (CID 119401596) is N-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide.
What is the SMILES notation for N-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide?
The canonical SMILES for N-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide is O=C(NC(CC(=O)N1CCNCC1)c1ccccc1)c1ccccc1.
What is the InChIKey of N-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide?
The InChIKey is OWPKPGWGEVGNDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c24-19(23-13-11-21-12-14-23)15-18(16-7-3-1-4-8-16)22-20(25)17-9-5-2-6-10-17/h1-10,18,21H,11-15H2,(H,22,25).
What are the key properties of N-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide?
N-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide has a molecular weight of 337.42 g/mol, XLogP of 1.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide is sourced from PubChem (CID 119401596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).